CHEBI:29749 - ferulate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ferulate
ChEBI ID CHEBI:29749
Definition A monocarboxylic acid anion obtained by the deprotonation of the carboxy group of ferulic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11848, CHEBI:14259, CHEBI:24029
Supplier Information
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Formula C10H9O4
Net Charge -1
Average Mass 193.17606
Monoisotopic Mass 193.05063
InChI InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/p-1/b5-3+
InChIKey KSEBMYQBYZTDHS-HWKANZROSA-M
SMILES COc1cc(\C=C\C([O-])=O)ccc1O
ChEBI Ontology
Outgoing ferulate (CHEBI:29749) is a monocarboxylic acid anion (CHEBI:35757)
ferulate (CHEBI:29749) is conjugate base of ferulic acid (CHEBI:17620)
Incoming sodium ferulate (CHEBI:114954) has part ferulate (CHEBI:29749)
ferulic acid (CHEBI:17620) is conjugate acid of ferulate (CHEBI:29749)
IUPAC Name
(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Synonyms Sources
3-methoxy-4-hydroxy-trans-cinnamate ChEBI
trans-ferulate UniProt
Manual Xref Database
FERULIC-ACID MetaCyc
View more database links
Last Modified
22 August 2018